SCHEMBL1473887

SCHEMBL1473887

CCC(=O)c1ccc(NS(C)(=O)=O)c(C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.47
ADRB3 P13945 1/20 0.45
HPGD P15428 1/20 0.44
RECQL P46063 1/20 0.44
KDM4E B2RXH2 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.43
NEU3 Q9UQ49 1/20 0.43
KEAP1 Q14145 1/20 0.40
NFE2L2 Q16236 1/20 0.40
ALDH1A1 P00352 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
CTSL P07711 1/20 0.39
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
PPARA Q07869 1/20 0.39
KMT2A Q03164 2/20 0.39
PTGS2 P35354 1/20 0.38
TP53 P04637 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1475120 0.84 ADRB3 (0.45) NPC1ADRB3HPGDRECQLKDM4E
SCHEMBL13748165 0.83 ADRB3 (0.44) NPC1ADRB3HPGDRECQLKDM4E
SCHEMBL14038599 0.83 MAPT (0.50) HPGDALDH1A1
SCHEMBL5329433 0.82 NEU3 (0.60) NPC1KDM4ESMN1; SMN2HSD17B10NEU3
SCHEMBL1474880 0.82 SMN1; SMN2 (0.54) NPC1HPGDRECQLKDM4ESMN1; SMN2
SCHEMBL18969511 0.80 ATM (0.44) HPGDSMN1; SMN2ALDH1A1ATML3MBTL1
SCHEMBL14038485 0.80 ALDH1A1 (0.47) NPC1ADRB3HPGDRECQLKDM4E
SCHEMBL27545254 0.80 ADRB3 (0.47) NPC1ADRB3HPGDRECQLKDM4E
SCHEMBL27453670 0.80 ADRB3 (0.47) NPC1ADRB3HPGDRECQLKDM4E
SCHEMBL17826361 0.78 ESR1 (0.50) NPC1HPGDSMN1; SMN2ALDH1A1ATM

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1861359-B1 N-(N-SULFONYLAMINOMETHYL)CYCLOPROPANECARBOXAMIDE DERIVATIVES USEFUL FOR THE TREATMENT OF PAIN PFIZER (US) 2012-11-14 EP disclosed
US-7915448-B2 Substituted sulfonylaminoarylmethyl cyclopropanecarboxamide as VR1 receptor antagonists PFIZER INC. (US) 2011-03-29 US disclosed
US-20100035880-A1 SUBSTITUTED SULFONYLAMINOARYLMETHYL CYCLOPROPANECARBOXAMIDE AS VR1 RECEPTOR ANTAGONISTS PFIZER INC 2010-02-11 US disclosed
US-7622589-B2 Substituted sulfonylaminoarylmethyl cyclopropanecarboxamide as VR1 receptor antagonists PFIZER INC. (US) 2009-11-24 US disclosed
US-20060211741-A1 Substituted sulfonylaminoarylmethyl cyclopropanecarboxamide as VR1 receptor antagonists PFIZER, INC. 2006-09-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060211741-A1 Substituted sulfonylaminoarylmethyl cyclopropanecarboxamide as VR1 receptor antagonists CNR1, HVCN1, CNR2 NPC1 728/4885ADRB3 184/4885HPGD 3078/4885
US-20100035880-A1 SUBSTITUTED SULFONYLAMINOARYLMETHYL CYCLOPROPANECARBOXAMIDE AS VR1 RECEPTOR ANTAGONISTS CNR1, HVCN1, CNR2 NPC1 735/4885ADRB3 186/4885HPGD 3027/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.